1-[[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]methyl-methyl-amino]cyclopropane-1-carboxamide

Systemtic Name: 1-[[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]methyl-methyl-amino]cyclopropane-1-carboxamide Openeye Name: 1-[[4-(3-chloro-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl]methyl-methyl-amino]cyclopropanecarboxamide CAS Name: 1-[[4-(3-chloro-2-fluoroanilino)-7-methoxy-6-quinazolinyl]methyl-methylamino]-1-cyclopropanecarboxamide IUPAC Name: 1-[[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]methyl-methylamino]cyclopropane-1-carboxamide Traditional Name: 1-[[4-(3-chloro-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl]methyl-methyl-amino]cyclopropanecarboxamide Formula: C21H21ClFN5O2 MolecularWeight: 429.875143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC)C4(CC4)C(=O)N

Isomeric SMILES

CN(CC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C(=CC=C3)Cl)F)OC)C4(CC4)C(=O)N

InChI

InChI=1S/C21H21ClFN5O2/c1-28(21(6-7-21)20(24)29)10-12-8-13-16(9-17(12)30-2)25-11-26-19(13)27-15-5-3-4-14(22)18(15)23/h3-5,8-9,11H,6-7,10H2,1-2H3,(H2,24,29)(H,25,26,27)